2-[3-(4-methylphenyl)-6-oxidanylidene-pyridazin-1-yl]-N-[3-(4-methylpiperazin-4-ium-1-yl)carbonylphenyl]ethanamide

Systemtic Name: 2-[3-(4-methylphenyl)-6-oxidanylidene-pyridazin-1-yl]-N-[3-(4-methylpiperazin-4-ium-1-yl)carbonylphenyl]ethanamide Openeye Name: N-[3-(4-methylpiperazin-4-ium-1-carbonyl)phenyl]-2-[6-oxo-3-(p-tolyl)pyridazin-1-yl]acetamide CAS Name: 2-[3-(4-methylphenyl)-6-oxo-1-pyridazinyl]-N-[3-[(4-methyl-1-piperazin-4-iumyl)-oxomethyl]phenyl]acetamide IUPAC Name: 2-[3-(4-methylphenyl)-6-oxopyridazin-1-yl]-N-[3-(4-methylpiperazin-4-ium-1-carbonyl)phenyl]acetamide Traditional Name: 2-[6-keto-3-(p-tolyl)pyridazin-1-yl]-N-[3-(4-methylpiperazin-4-ium-1-carbonyl)phenyl]acetamide Formula: C25H28N5O3+ MolecularWeight: 446.52152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C(=O)C=C2)CC(=O)NC3=CC=CC(=C3)C(=O)N4CC[NH+](CC4)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C(=O)C=C2)CC(=O)NC3=CC=CC(=C3)C(=O)N4CC[NH+](CC4)C

InChI

InChI=1S/C25H27N5O3/c1-18-6-8-19(9-7-18)22-10-11-24(32)30(27-22)17-23(31)26-21-5-3-4-20(16-21)25(33)29-14-12-28(2)13-15-29/h3-11,16H,12-15,17H2,1-2H3,(H,26,31)/p+1